libxc 5.1.6-GCC-11.2.0

Libxc is a library of exchange-correlation functionals for density-functional theory. The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals.

Accessing libxc 5.1.6-GCC-11.2.0

To load the module for libxc 5.1.6-GCC-11.2.0 please use this command on the BEAR systems (BlueBEAR, BEARCloud VMs, and CaStLeS VMs):

module load libxc/5.1.6-GCC-11.2.0

BEAR Apps Version

2021a

More Information

For more information visit the libxc website.

Dependencies

This version of libxc has a direct dependency on: GCC/11.2.0

Required By

This version of libxc is a direct dependent of: CP2K/2023.1-foss-2021b-CUDA-11.4.1 CP2K/2023.1-foss-2021b QuantumESPRESSO/7.0-foss-2021b

Other Versions

These versions of libxc are available on the BEAR systems (BlueBEAR, BEARCloud VMs, and CaStLeS VMs). These will be retained in accordance with our Applications Support and Retention Policy.

Last modified on 20th June 2022